SB234551 [7122]
SB234551
| SMILES | CCCCn1ncc(/C=C(\Cc2cc3c(cc2OC)OCO3)C(=O)O)c1-c1ccc(OC)cc1OCc1ccccc1C(=O)O |
| InChIKey | MCHCGWZNXSZKJY-OEAKJJBVSA-N |
Chemical Properties
| Hydrogen bond acceptors | 9 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 14 |
| Log P | 6.084 |
| Molecular weight (Da) | 614.2 |
| Stereochemistry info | unspecified |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
SB234551
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0